CAS No.: 16423-19-1 — - (-) | Kehua Intelligence

1. Primary Information

English name:	-
CAS No.:	16423-19-1
Molecular formula:	-
Molecular weight:	- g/mol
SMILES:	-
Structural class:
Other identifiers:	-

2. Suppliers & Pricing

Supplier	Pack size	Purity	Price (CNY)	Storage conditions	Lead time	Notes
Kehua Intelligence	1ml	100mg/L于甲醇	720	-20℃	in stock	-
Kehua Intelligence	1mg	100mg/L于甲醇	2400	RT	in stock	-
Kehua Intelligence	10mg	100mg/L于甲醇	17841	RT	in stock	-

3. Structures

3.1 2D structure

3.2 3D structure

-1 -2 -3 35 36 0 1 0 0 0 0 0999 V2000 0.1630 0.8431 -1.5051 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3734 -0.9327 0.1141 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0474 0.5652 -0.0945 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4665 0.8200 0.4966 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6676 -1.8511 -0.5759 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7684 -1.1827 -0.5196 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0264 1.5203 0.4687 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4994 -0.1303 -0.1494 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0964 -1.6020 -0.0885 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8402 -0.2263 0.0079 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4280 1.2389 -0.0874 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4596 -1.3273 1.6148 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9557 2.2648 0.3182 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4496 0.6301 1.5764 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -1.7011 -1.6629 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4127 -2.9054 -0.4094 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0900 -2.2147 -0.3288 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7152 -1.0885 -1.6112 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7873 2.5578 0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0503 1.4664 1.5629 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4715 -0.0099 0.3447 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6548 0.1481 -1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7926 -2.1923 -0.6964 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2112 -1.9672 0.9382 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0775 -0.4691 1.0499 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7688 -0.3785 -0.5549 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4749 1.5555 -1.1364 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1592 1.8577 0.4463 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1665 -0.7075 2.1728 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7903 -2.3676 1.7197 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4991 -1.2488 2.1331 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9609 2.5665 -0.7341 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3287 2.9678 0.8746 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9762 2.3751 0.7016 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6957 0.7080 -1.9342 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 5 1 0 0 0 0 2 6 1 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 8 1 0 0 0 0 4 13 1 0 0 0 0 4 14 1 0 0 0 0 5 9 1 0 0 0 0 5 15 1 0 0 0 0 5 16 1 0 0 0 0 6 10 1 0 0 0 0 6 17 1 0 0 0 0 6 18 1 0 0 0 0 7 11 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0

4. International Nomenclature & Identifiers

4.1 IUPAC Name

(4R,4aR,8aS)-4,8a-dimethyl-1,2,3,4,5,6,7,8-octahydronaphthalen-4a-ol

4.2 InChI

InChI=1S/C12H22O/c1-10-6-5-8-11(2)7-3-4-9-12(10,11)13/h10,13H,3-9H2,1-2H3/t10-,11+,12-/m1/s1

4.3 InChIKey

JLPUXFOGCDVKGO-GRYCIOLGSA-N

4.4 Canonical SMILES

CC1CCCC2(C1(CCCC2)O)C

4.5 Isomeric SMILES

C[C@@H]1CCC[C@]2([C@]1(CCCC2)O)C

4.6 SDF file

Coming soon

5. Spectroscopic data

5.1 ¹³C nuclear magnetic resonance (¹³C NMR)

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5.2 ¹H nuclear magnetic resonance (¹H NMR)

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5.3 Mass spectrometry (MS)

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5.4 Infrared spectroscopy (IR)

Coming soon

5.5 Ultraviolet/visible spectroscopy (UV/Vis)

Coming soon

1. Primary Information

2. Suppliers & Pricing

3. Structures

3.1 2D structure

3.2 3D structure

4. International Nomenclature & Identifiers

4.1 IUPAC Name

4.2 InChI

4.3 InChIKey

4.4 Canonical SMILES

4.5 Isomeric SMILES

4.6 SDF file

5. Spectroscopic data

5.1 13C nuclear magnetic resonance (13C NMR)

5.2 1H nuclear magnetic resonance (1H NMR)

5.3 Mass spectrometry (MS)

5.4 Infrared spectroscopy (IR)

5.5 Ultraviolet/visible spectroscopy (UV/Vis)

5.1 ¹³C nuclear magnetic resonance (¹³C NMR)

5.2 ¹H nuclear magnetic resonance (¹H NMR)