CID 3051562

67466-48-2

Structural Information

Molecular Formula

C₁₀H₁₉NO

SMILES

C1CCC(CC1)C2(CCNC2)O

InChI

InChI=1S/C10H19NO/c12-10(6-7-11-8-10)9-4-2-1-3-5-9/h9,11-12H,1-8H2

InChIKey

RLWFGBSSLZGGIE-UHFFFAOYSA-N

Compound name

3-cyclohexylpyrrolidin-3-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 13
Patents: 169.14667 Da
Monoisotopic Mass: 1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	170.15395	141.7
[M+Na]+	192.13589	144.9
[M-H]-	168.13939	143.0
[M+NH4]+	187.18049	162.4
[M+K]+	208.10983	142.0
[M+H-H2O]+	152.14393	135.4
[M+HCOO]-	214.14487	156.8
[M+CH3COO]-	228.16052	170.8
[M+Na-2H]-	190.12134	144.3
[M]+	169.14612	131.4
[M]-	169.14722	131.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe