CID 93629690

{[(2s,4s)-4-methoxypyrrolidin-2-yl]methyl}dimethylamine

Structural Information

Molecular Formula
C8H18N2O
SMILES
CN(C)C[C@@H]1C[C@@H](CN1)OC
InChI
InChI=1S/C8H18N2O/c1-10(2)6-7-4-8(11-3)5-9-7/h7-9H,4-6H2,1-3H3/t7-,8-/m0/s1
InChIKey
IQISVOXVRFMPPE-YUMQZZPRSA-N
Compound name
1-[(2S,4S)-4-methoxypyrrolidin-2-yl]-N,N-dimethylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

158.1419 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.14918 137.2
[M+Na]+ 181.13112 142.5
[M-H]- 157.13462 138.9
[M+NH4]+ 176.17572 158.3
[M+K]+ 197.10506 142.5
[M+H-H2O]+ 141.13916 130.7
[M+HCOO]- 203.14010 158.8
[M+CH3COO]- 217.15575 180.6
[M+Na-2H]- 179.11657 139.9
[M]+ 158.14135 135.4
[M]- 158.14245 135.4
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

No patent data available for this compound.