CID 54368474

4-(propan-2-yloxy)cyclohexan-1-amine hydrochloride

Structural Information

Molecular Formula
C9H19NO
SMILES
CC(C)OC1CCC(CC1)N
InChI
InChI=1S/C9H19NO/c1-7(2)11-9-5-3-8(10)4-6-9/h7-9H,3-6,10H2,1-2H3
InChIKey
VIBZEOYMXOCRTD-UHFFFAOYSA-N
Compound name
4-propan-2-yloxycyclohexan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

64
Patents

157.14667 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.15395 137.4
[M+Na]+ 180.13589 141.5
[M-H]- 156.13939 139.7
[M+NH4]+ 175.18049 157.8
[M+K]+ 196.10983 140.9
[M+H-H2O]+ 140.14393 131.7
[M+HCOO]- 202.14487 157.2
[M+CH3COO]- 216.16052 180.6
[M+Na-2H]- 178.12134 139.8
[M]+ 157.14612 132.4
[M]- 157.14722 132.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe