CID 3048065

Usaf la-21

Structural Information

Molecular Formula
C10H17N3
SMILES
CNCCN(CC1=CC=CC=C1)N
InChI
InChI=1S/C10H17N3/c1-12-7-8-13(11)9-10-5-3-2-4-6-10/h2-6,12H,7-9,11H2,1H3
InChIKey
WNTOUDNTIDTFNQ-UHFFFAOYSA-N
Compound name
2-[amino(benzyl)amino]-N-methylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

179.14224 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.149516 140.2
[M+Na]+ 202.131458 144.7
[M-H]- 178.134964 144.3
[M+NH4]+ 197.176063 159.6
[M+K]+ 218.105398 143.5
[M+H-H2O]+ 162.139500 132.9
[M+HCOO]- 224.140441 167.4
[M+CH3COO]- 238.156091 191.9
[M+Na-2H]- 200.116906 147.0
[M]+ 179.14169142 138.5
[M]- 179.14278858 138.5
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