CID 115011214

4-methoxy-3,3-dimethylpyrrolidine

Structural Information

Molecular Formula
C7H15NO
SMILES
CC1(CNCC1OC)C
InChI
InChI=1S/C7H15NO/c1-7(2)5-8-4-6(7)9-3/h6,8H,4-5H2,1-3H3
InChIKey
ULABXABPWDXDFQ-UHFFFAOYSA-N
Compound name
4-methoxy-3,3-dimethylpyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

129.11537 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.122646 127.7
[M+Na]+ 152.104588 135.2
[M-H]- 128.108094 128.6
[M+NH4]+ 147.149193 151.7
[M+K]+ 168.078528 134.3
[M+H-H2O]+ 112.112630 123.1
[M+HCOO]- 174.113571 148.2
[M+CH3COO]- 188.129221 168.8
[M+Na-2H]- 150.090036 132.6
[M]+ 129.11482142 125.4
[M]- 129.11591858 125.4
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