CID 58903082

1842337-34-1

Structural Information

Molecular Formula
C7H15NO2
SMILES
CN1C[C@H](C[C@H]1CO)OC
InChI
InChI=1S/C7H15NO2/c1-8-4-7(10-2)3-6(8)5-9/h6-7,9H,3-5H2,1-2H3/t6-,7-/m0/s1
InChIKey
KFMNERGCJJKMDP-BQBZGAKWSA-N
Compound name
[(2S,4S)-4-methoxy-1-methylpyrrolidin-2-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

72
Patents

145.11028 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.117556 131.4
[M+Na]+ 168.099498 138.8
[M-H]- 144.103004 132.2
[M+NH4]+ 163.144103 153.0
[M+K]+ 184.073438 138.1
[M+H-H2O]+ 128.107540 125.9
[M+HCOO]- 190.108481 152.0
[M+CH3COO]- 204.124131 172.4
[M+Na-2H]- 166.084946 134.4
[M]+ 145.10973142 130.6
[M]- 145.11082858 130.6
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