CID 82418713

1,2,2-trimethylpyrrolidin-3-ol hydrochloride

Structural Information

Molecular Formula
C7H15NO
SMILES
CC1(C(CCN1C)O)C
InChI
InChI=1S/C7H15NO/c1-7(2)6(9)4-5-8(7)3/h6,9H,4-5H2,1-3H3
InChIKey
ZPGSNALNPFRXCK-UHFFFAOYSA-N
Compound name
1,2,2-trimethylpyrrolidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

129.11537 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.122646 126.6
[M+Na]+ 152.104588 135.1
[M-H]- 128.108094 127.9
[M+NH4]+ 147.149193 151.0
[M+K]+ 168.078528 134.1
[M+H-H2O]+ 112.112630 122.4
[M+HCOO]- 174.113571 147.1
[M+CH3COO]- 188.129221 169.9
[M+Na-2H]- 150.090036 131.0
[M]+ 129.11482142 124.7
[M]- 129.11591858 124.7
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