CID 265375

2-methyl-3-phenylaziridine

Structural Information

Molecular Formula
C9H11N
SMILES
CC1C(N1)C2=CC=CC=C2
InChI
InChI=1S/C9H11N/c1-7-9(10-7)8-5-3-2-4-6-8/h2-7,9-10H,1H3
InChIKey
NWAQGFVFBBSDAV-UHFFFAOYSA-N
Compound name
2-methyl-3-phenylaziridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

40
Patents

133.08914 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.09642 127.4
[M+Na]+ 156.07836 137.3
[M-H]- 132.08186 132.6
[M+NH4]+ 151.12296 142.8
[M+K]+ 172.05230 133.7
[M+H-H2O]+ 116.08640 120.7
[M+HCOO]- 178.08734 149.9
[M+CH3COO]- 192.10299 140.9
[M+Na-2H]- 154.06381 135.0
[M]+ 133.08859 127.4
[M]- 133.08969 127.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe